Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 9/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 3/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.32 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.32 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.32 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acridine SCHEMBL28941669 | 0.86 | HTR3A (0.51) | ACHEMAPTEGFRCTDSP1BCHE | |
| SCHEMBL1913663 | 0.86 | ACHE (0.42) | ACHEMAPTEGFRNOS3NOS1 | |
| Naphthylamine SCHEMBL27794071 | 0.85 | ALDH1A1 (0.49) | ACHEMAPTEGFRKIF11 | |
| SCHEMBL28763087 | 0.84 | HPRT1 (0.43) | ACHEMAPTEGFRCTDSP1KIF11 | |
| Benzidine SCHEMBL27870798 | 0.80 | KIF11 (0.43) | ACHEMAPTKIF11BCHECHRM1 | |
| SCHEMBL27883311 | 0.79 | CYP1A2 (0.43) | ACHEMAPTSTAT3BCHEGRIN1 | |
| SCHEMBL27440395 | 0.79 | HPRT1 (0.50) | ACHEMAPTKIF11BCHECHRM1 | |
| Benzidine SCHEMBL27702466 | 0.79 | KIF11 (0.42) | ACHEMAPTKIF11BCHE | |
| SCHEMBL2107085 | 0.77 | CTDSP1 (0.54) | ACHEMAPTCTDSP1 | |
| SCHEMBL30928215 | 0.77 | HPRT1 (0.54) | ACHEMAPTKIF11 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107922335-A | Hexamethyl dihydroindene | 默克专利有限公司 | 2018-04-17 | — | — | CN | disclosed |